%chk=000225006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225006

0 1
O 1.562054 -2.733813 0.329826
O -0.442199 -3.884005 -0.034596
O 0.282856 -0.266109 -1.933287
O -0.691822 -0.282068 2.469775
O 5.527352 2.274339 0.661571
O -5.357499 2.219287 -1.100767
N 0.644948 -3.229084 -0.674828
N -1.177173 -3.001853 0.737771
C 0.571511 -1.797985 -0.186353
C -0.669330 -1.799472 0.681792
C 0.987733 -0.568887 -0.996878
C -1.190820 -0.579893 1.410338
C 2.174928 0.161978 -0.555503
C -2.275821 0.154682 0.746548
C 2.854954 -0.130238 0.649480
C 2.641005 1.208717 -1.378581
C -2.566320 0.001279 -0.627545
C -3.038293 1.047361 1.524251
C 3.969858 0.600247 1.022033
C 3.761571 1.953445 -1.026238
C 4.420024 1.641719 0.175874
C -3.602619 0.712490 -1.208656
C -4.089323 1.767741 0.963229
C -4.364776 1.590792 -0.402785
C 6.095273 3.364195 -0.111171
C -6.218235 3.146824 -0.390545
H 2.500472 -0.938143 1.299980
H 2.105164 1.430976 -2.308770
H -1.958446 -0.668144 -1.248064
H -2.795961 1.169586 2.585729
H 4.506779 0.393755 1.947406
H 4.108653 2.753322 -1.672411
H -3.841127 0.613879 -2.266947
H -4.672278 2.446158 1.577229
H 6.433264 3.001634 -1.086194
H 6.947711 3.658641 0.516755
H 5.373720 4.181180 -0.201246
H -5.633286 3.985275 -0.002029
H -6.767399 2.625858 0.399030
H -6.896007 3.475932 -1.190223


%chk=000225006-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225006

0 1
O 1.324502 -2.245872 0.749879
O -0.437135 -3.383505 -0.647102
O 1.090717 0.070313 -2.163609
O -0.474019 0.977016 0.657203
O 6.344331 2.021334 1.077451
O -6.858975 1.391549 -0.214856
N 1.025931 -2.798600 -0.676982
N -1.362678 -2.345040 -0.325455
C 0.771901 -1.344991 -0.320576
C -0.720708 -1.190949 -0.198304
C 1.578831 -0.264977 -1.039284
C -1.313172 0.124184 0.206102
C 2.815166 0.296264 -0.473761
C -2.758442 0.414416 0.091179
C 3.241453 0.069261 0.869632
C 3.600522 1.138716 -1.309450
C -3.713767 -0.487125 -0.468770
C -3.208495 1.681336 0.558451
C 4.415097 0.662146 1.350590
C 4.782569 1.732094 -0.841127
C 5.194144 1.491038 0.499393
C -5.064912 -0.128791 -0.553219
C -4.559811 2.051403 0.480559
C -5.496671 1.139413 -0.080196
C 7.199104 2.888263 0.254345
C -7.375947 2.687523 0.246510
H 2.651634 -0.562624 1.537321
H 3.257071 1.316089 -2.334097
H -3.396869 -1.468128 -0.831237
H -2.466891 2.366117 0.982912
H 4.755143 0.504702 2.378062
H 5.369458 2.370847 -1.507140
H -5.808451 -0.807079 -0.981360
H -4.875231 3.031305 0.849772
H 7.586726 2.343787 -0.627221
H 8.031690 3.172695 0.913136
H 6.651919 3.792805 -0.071598
H -6.910131 3.522740 -0.309584
H -7.210537 2.818306 1.332541
H -8.453973 2.653614 0.034889


